Structure Information
Structure

Compound Identification

SMILES

CC1(C)C=CN2[C@@H](C[C@]11NC3=CC=CC=C3C1=O)C(=O)N1CCC=C1C2=O

InChIKey

InChIKey=LBFQJHHYMJAUKS-HRAATJIYSA-N

Formula

C21H21N3O3

Mass

363.417

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Piperazinoazepines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Piperazinoazepines

Alternative Parents

Alpha amino acids and derivatives Indolines Aryl alkyl ketones 2,5-dioxopiperazines Secondary alkylarylamines N-alkylpiperazines Azepines Benzenoids Vinylogous amides Tertiary carboxylic acid amides Pyrrolines Lactams Azacyclic compounds Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Piperazino-azepine - Alpha-amino acid or derivatives - Indole or derivatives - Dihydroindole - Dioxopiperazine - 2,5-dioxopiperazine - Aryl alkyl ketone - Aryl ketone - Azepine - Secondary aliphatic/aromatic amine - N-alkylpiperazine - 1,4-diazinane - Piperazine - Benzenoid - Pyrroline - Vinylogous amide - Tertiary carboxylic acid amide - Amino acid or derivatives - Lactam - Ketone - Carboxamide group - Secondary amine - Azacycle - Carboxylic acid derivative - Amine - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as piperazinoazepines. These are compounds containing a piperazinoazepine skeleton, which consists of an azepine ring fused to a piperazine.

External Descriptors

Not available

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